SCHEMBL20937431

SCHEMBL20937431

Cc1ccc(-c2ccc3c4ccccc4n(-c4cc(-c5cccnc5)ccc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
HTT P42858 2/20 0.41
MAPK1 P28482 1/20 0.41
MDM2 Q00987 1/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GBA1 P04062 3/20 0.38
USP1 O94782 1/20 0.38
WDR48 Q8TAF3 1/20 0.38
CYP11B2 P19099 4/20 0.38
CYP3A4 P08684 2/20 0.38
CYP17A1 P05093 2/20 0.38
CYP19A1 P11511 2/20 0.38
CYP11B1 P15538 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
GLA P06280 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20937402 0.97 MAPT (0.40) MAPTHTTMAPK1MDM2MEN1
SCHEMBL20937379 0.95 MAPT (0.39) MAPTHTTMAPK1MDM2MEN1
SCHEMBL20937399 0.95 CYP11B1 (0.40) MAPTMAPK1MEN1KMT2AGBA1
SCHEMBL20937437 0.94 MAPT (0.41) MAPTHTTMAPK1MDM2MEN1
SCHEMBL20937436 0.93 MAPT (0.38) MAPTHTTMAPK1MDM2MEN1
SCHEMBL20937403 0.92 MAPT (0.42) MAPTHTTMAPK1MDM2MEN1
SCHEMBL20937841 0.92 MAPT (0.41) MAPTHTTMAPK1MDM2MEN1
SCHEMBL20937368 0.92 MAPT (0.41) MAPTHTTMAPK1MEN1KMT2A
SCHEMBL20937433 0.92 CYP11B1 (0.43) MAPTMAPK1MEN1KMT2ACYP11B2
SCHEMBL20937425 0.91 MAPT (0.40) MAPTHTTMAPK1MDM2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019076844-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-25 WO disclosed